2-(1-benzyl-3-methylsulfanylindol-2-yl)acetic acid
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2-(1-benzyl-3-methylsulfanylindol-2-yl)acetic acid
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CAS No:
296245-95-9
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Formula:
C18H17NO2S
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Chemical Name:
2-(1-benzyl-3-methylsulfanylindol-2-yl)acetic acid
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Synonyms:
[1-Benzyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid;NSC717540;Oprea1_061936;Oprea1_553894;(1-Benzyl-3-methylsulfanyl-1H-indol-2-yl)-acetic acid;CHEMBL1986158;ZINC380731;STK025512;AKOS001636116;CCG-110714;MCULE-4516785646;NSC-717540;NCI60_040573;SR-01000517360;SR-01000517360-1;Acetic acid, 2-(1-benzyl-3-methylthio-2-indolyl)-;[1-Benzyl-3-(methylsulfanyl)-1H-indol-2-yl]acetic acid #;296245-95-9
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CAS No:
2-(1-benzyl-3-methylsulfanylindol-2-yl)acetic acid Basic Attributes
311.4 g/mol
311.09799996 g/mol
717540
Computed Properties
Molecular Weight:311.4
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:311.09799996
Monoisotopic Mass:311.09799996
Topological Polar Surface Area:67.5
Heavy Atom Count:22
Complexity:383
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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